6-[(dodecylamino)methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(dodecylamino)methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(dodecylamino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[(dodecylamino)methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(dodecylamino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[(laurylamino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C19H30N2O3 MolecularWeight: 334.4531

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC=C1C=C(C=CC1=O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCNC=C1C=C(C=CC1=O)[N+](=O)[O-]

InChI

InChI=1S/C19H30N2O3/c1-2-3-4-5-6-7-8-9-10-11-14-20-16-17-15-18(21(23)24)12-13-19(17)22/h12-13,15-16,20H,2-11,14H2,1H3